4N1Q
Structure of Cyclophilin A in complex with cyclohexanecarboxamide.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2009-10-16 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.00000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 43.150, 54.270, 88.260 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.940 - 1.650 |
R-factor | 0.18184 |
Rwork | 0.180 |
R-free | 0.22019 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.026 |
RMSD bond angle | 1.850 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.850 | 1.740 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 22651 | |
Completeness [%] | 88.4 | 88.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | Tris, PEG8000, VAPOR DIFFUSION, HANGING DROP, temperature 277K |